| SpectraBase Compound ID | 7Ht0598CJ0E |
|---|---|
| InChI | InChI=1S/C20H19F3N2O3/c21-20(22,23)28-15-10-8-14(9-11-15)19(27)24-12-18(26)25-17-7-3-5-13-4-1-2-6-16(13)17/h1-2,4,6,8-11,17H,3,5,7,12H2,(H,24,27)(H,25,26)/t17-/m1/s1 |
| InChIKey | MLHQXLYJVYMVNC-QGZVFWFLSA-N |
| Mol Weight | 392.38 g/mol |
| Molecular Formula | C20H19F3N2O3 |
| Exact Mass | 392.134777 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8GzPcWvuNpy |
|---|---|
| Name | (R)-N-(2-oxo-2-((1,2,3,4-Tetrahydronaphthalen-1-yl)amino)ethyl)-4-(trifluoromethoxy)benzamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 392.134776966 u |
| Formula | C20H19F3N2O3 |
| InChI | InChI=1S/C20H19F3N2O3/c21-20(22,23)28-15-10-8-14(9-11-15)19(27)24-12-18(26)25-17-7-3-5-13-4-1-2-6-16(13)17/h1-2,4,6,8-11,17H,3,5,7,12H2,(H,24,27)(H,25,26)/t17-/m1/s1 |
| InChIKey | MLHQXLYJVYMVNC-QGZVFWFLSA-N |
| Molecular Weight | 392.378 g/mol |
| SMILES | C(C1=CC=C(C=C1)OC(F)(F)F)(=O)NCC(N[C@@]1(CCCC2=C1C=CC=C2)[H])=O |